Optimizing ligand conformations in flexible protein targets: a multi-objective strategy.
Esteban López-CamachoMaría Jesús García-GodoyJosé García-NietoAntonio J. NebroJosé Francisco Aldana MontesPublished in: Soft Comput. (2020)
Keyphrases
- multi objective
- protein structure
- protein structure prediction
- drug design
- amino acids
- protein folding
- multi objective optimization
- evolutionary algorithm
- optimization algorithm
- protein protein
- genetic algorithm
- drug discovery
- objective function
- particle swarm optimization
- protein sequences
- nsga ii
- virtual screening
- multiobjective optimization
- low energy
- multiple objectives
- secondary structure
- sequence analysis
- amino acid sequences
- molecular biology
- computational biology
- protein function
- conflicting objectives
- multi objective optimization problems
- contact map
- optimum design
- protein interaction data
- optimal solution
- structural motifs